S087-garnet

Structure Type 087: Ca₃Fe₂Si₃O₁₂ (Garnet)

(Si blue, O red, Fe dark gray, Ca green)

Crystal Structure Data

Spacegroup Symbol:
I a 3 d

Origin Offset:
(none)

Lattice Type:
I

Unit Cell Parameters

a [A]

b [A]

c [A]

alpha [deg]

beta [deg]

gamma [deg]

12.0300

12.0300

12.0300

90.000

90.000

90.000

Fractional Coordinates of Atoms in the Asymmetric Unit

Site Label

Element

x

y

z

dod

Ca

0.1250

0.0000

0.2500

octa

Fe

0.0000

0.0000

0.0000

O

O

0.0395

0.0488

0.6556

tetr

Si

0.3750

0.0000

0.2500

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Spacegroup Symbol:	`I a 3 d`
Origin Offset:	`(none)`
Lattice Type:	`I`

Unit Cell Parameters
a [A]	b [A]	c [A]	alpha [deg]	beta [deg]	gamma [deg]
`12.0300`	`12.0300`	`12.0300`	`90.000`	`90.000`	`90.000`

Fractional Coordinates of Atoms in the Asymmetric Unit
Site Label	Element	x	y	z
`dod`	`Ca`	`0.1250`	`0.0000`	`0.2500`
`octa`	`Fe`	`0.0000`	`0.0000`	`0.0000`
`O`	`O`	`0.0395`	`0.0488`	`0.6556`
`tetr`	`Si`	`0.3750`	`0.0000`	`0.2500`